SCHEMBL9307318

SCHEMBL9307318

O=c1c2ccccc2nc2cccnn12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.56
SMN1; SMN2 Q16637 8/20 0.56
ALDH1A1 P00352 7/20 0.56
GLA P06280 1/20 0.56
GAA P10253 1/20 0.56
NPC1 O15118 5/20 0.51
RAB9A P51151 5/20 0.51
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
MITF O75030 1/20 0.45
PKM P14618 1/20 0.45
HSD17B10 Q99714 4/20 0.43
HPGD P15428 3/20 0.43
POLB P06746 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
CASP1 P29466 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2674833 0.74 ALDH1A1 (0.41) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL8100877 0.73 SMN1; SMN2 (0.56) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL203981 0.72 KDM4E (0.41) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL2427657 0.71 KDM4E (1.00) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL9306694 0.71 SMN1; SMN2 (0.53) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL25311041 0.70 PDE4A (0.42) KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A
Hydrochloric Acid SCHEMBL30228536 0.70 KDM4E (0.96) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL203984 0.70 TLR7 (0.46) POLBLMNA
SCHEMBL11385268 0.70 SMN1; SMN2 (0.52) KDM4ESMN1; SMN2ALDH1A1GLAGAA
SCHEMBL31649679 0.68 KDM4E (0.63) KDM4ESMN1; SMN2ALDH1A1GLAGAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5340808-A Fused pyridazinoquinazolone derivatives as neurotrophic agents WARNER LAMBERT COMPANY (US) 1994-08-23 US disclosed
US-4250177-A ANTIALLERGENS WARNER-LAMBERT COMPANY (US) 1981-02-10 US disclosed